[[4-cyano-2-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-2-ium-3-yl]amino]methylidene-dimethyl-azanium

Systemtic Name: [[4-cyano-2-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-2-ium-3-yl]amino]methylidene-dimethyl-azanium Openeye Name: [[4-cyano-2-[5-(trifluoromethyl)-2-pyridyl]-1H-pyrazol-2-ium-3-yl]amino]methylene-dimethyl-ammonium CAS Name: [[4-cyano-2-[5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-2-ium-3-yl]amino]methylidene-dimethylammonium IUPAC Name: [[4-cyano-2-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazol-2-ium-3-yl]amino]methylidene-dimethylazanium Traditional Name: [[4-cyano-2-[5-(trifluoromethyl)-2-pyridyl]-1H-pyrazol-2-ium-3-yl]amino]methylene-dimethyl-ammonium Formula: C13H13F3N6+2 MolecularWeight: 310.27773

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CNC1=[N+](NC=C1C#N)C2=NC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

C[N+](=CNC1=[N+](NC=C1C#N)C2=NC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C13H11F3N6/c1-21(2)8-19-12-9(5-17)6-20-22(12)11-4-3-10(7-18-11)13(14,15)16/h3-4,6-8H,1-2H3/p+2